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E138-01 Forschungsbereich Computational Materials Science
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E138-01 Forschungsbereich Computational Materials Science
DFT + DMFT tutorial (NiO)
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File
projwfc.in
0.2 kB
Simone Di Cataldo
13.04.2023 14:17
No labels
Version 1 (current)
0.2 kB
Simone Di Cataldo
13.04.2023 14:17
File
NiO.O.dos.dat
299 kB
Simone Di Cataldo
13.04.2023 14:17
No labels
Version 1 (current)
299 kB
Simone Di Cataldo
13.04.2023 14:17
File
NiO.Ni.dos.dat
299 kB
Simone Di Cataldo
13.04.2023 14:17
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Version 1 (current)
299 kB
Simone Di Cataldo
13.04.2023 14:17
File
NiO.nscf.in
0.8 kB
Simone Di Cataldo
13.04.2023 14:17
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Version 1 (current)
0.8 kB
Simone Di Cataldo
13.04.2023 14:17
File
dos.in
0.1 kB
Simone Di Cataldo
13.04.2023 14:17
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Version 1 (current)
0.1 kB
Simone Di Cataldo
13.04.2023 14:17
File
plot_bands.ipynb
75 kB
Simone Di Cataldo
12.04.2023 17:35
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Version 1 (current)
75 kB
Simone Di Cataldo
12.04.2023 17:35
File
NiO.bands.in
0.9 kB
Simone Di Cataldo
12.04.2023 17:00
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Version 1 (current)
0.9 kB
Simone Di Cataldo
12.04.2023 17:00
File
bands.in
0.1 kB
Simone Di Cataldo
12.04.2023 17:00
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Version 1 (current)
0.1 kB
Simone Di Cataldo
12.04.2023 17:00
PNG File
Screenshot 2023-04-12 at 16.44.08.png
170 kB
Simone Di Cataldo
12.04.2023 16:45
No labels
Version 1 (current)
170 kB
Simone Di Cataldo
12.04.2023 16:45
File
NiO.relax.out
75 kB
Simone Di Cataldo
12.04.2023 16:26
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Version 1 (current)
75 kB
Simone Di Cataldo
12.04.2023 16:26
File
NiO.relax.in
0.8 kB
Simone Di Cataldo
12.04.2023 16:26
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Version 1 (current)
0.8 kB
Simone Di Cataldo
12.04.2023 16:26
File
NiO.scf.out
14 kB
Simone Di Cataldo
12.04.2023 16:25
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Version 1 (current)
14 kB
Simone Di Cataldo
12.04.2023 16:25
File
plot_convergence.py
0.5 kB
Simone Di Cataldo
02.03.2023 10:31
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Version 1 (current)
0.5 kB
Simone Di Cataldo
02.03.2023 10:31
File
CONVERGE_ECUT.sh
0.4 kB
Simone Di Cataldo
02.03.2023 10:31
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Version 1 (current)
0.4 kB
Simone Di Cataldo
02.03.2023 10:31
File
NiO.src.in
0.8 kB
Simone Di Cataldo
02.03.2023 10:31
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Version 1 (current)
0.8 kB
Simone Di Cataldo
02.03.2023 10:31
PNG File
ECUT_CONV.png
23 kB
Simone Di Cataldo
02.03.2023 10:28
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Version 2 (current)
23 kB
Simone Di Cataldo
02.03.2023 10:28
Version 1
22 kB
Simone Di Cataldo
02.03.2023 10:27
File
O_ONCV_PBE_sr.upf
136 kB
Simone Di Cataldo
01.03.2023 18:19
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Version 1 (current)
136 kB
Simone Di Cataldo
01.03.2023 18:19
File
Ni_ONCV_PBE_sr.upf
252 kB
Simone Di Cataldo
01.03.2023 18:19
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Version 1 (current)
252 kB
Simone Di Cataldo
01.03.2023 18:19
PNG File
Screenshot 2023-03-01 at 17.10.22.png
925 kB
Simone Di Cataldo
01.03.2023 17:10
No labels
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925 kB
Simone Di Cataldo
01.03.2023 17:10
PNG File
Screenshot 2023-03-01 at 17.08.52.png
979 kB
Simone Di Cataldo
01.03.2023 17:08
No labels
Version 1 (current)
979 kB
Simone Di Cataldo
01.03.2023 17:08
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